Geometry & MOs

Info

ID:	294401
PubChem CID:	117459105
Reduced:	BrO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	284.05243
ΔH_f, kcal/mol:	-62.38
Dipole, Da:	5.13
IP(EA), eV:	-8.74(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-bromo-4-(1-methylpyrrolidin-3-yl)phenyl]methyl]hydroxylamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)CC2(CC2)O)Br)C

DOS

IR

Vibrations